Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | TK1 | P04183 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9739838 | 1.00 | ALDH1A1 (0.42) | ALDH1A1ALOX5MAPTHTTTSHR | |
| SCHEMBL9738756 | 0.78 | HTT (0.38) | ALOX5MAPTHTTTSHRTK1 | |
| SCHEMBL9738759 | 0.78 | HTT (0.38) | ALOX5MAPTHTTTSHRTK1 | |
| SCHEMBL9739110 | 0.76 | CA1 (0.44) | ALOX5MAPTHTTTSHRTK1 | |
| SCHEMBL9550255 | 0.76 | CA1 (0.44) | ALOX5MAPTHTTTSHRTK1 | |
| SCHEMBL9550253 | 0.76 | CA1 (0.44) | ALOX5MAPTHTTTSHRTK1 | |
| SCHEMBL9739112 | 0.76 | CA1 (0.44) | ALOX5MAPTHTTTSHRTK1 | |
| SCHEMBL9818494 | 0.76 | HTT (0.36) | ALOX5MAPTHTTTSHRTK1 | |
| SCHEMBL9818492 | 0.76 | HTT (0.36) | ALOX5MAPTHTTTSHRTK1 | |
| SCHEMBL567380 | 0.73 | PPARA (0.40) | ALDH1A1ALOX5MAPTSMN1; SMN2PPARA |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5097075-A | 1,1,1-TRIFLUORO-2-HYDROXY COMPOUND | SHOWA SHELL SEKIYU KABUSHIKI KAISHA (JP) | 1992-03-17 | — | — | US | disclosed |
| EP-0423992-A1 | 1,1,1-Trifluoro-2-hydroxy compound | Showa Shell Sekiyu Kabushiki Kaisha (JP) | 1991-04-24 | — | — | EP | disclosed |